Stilbamidine Isetionate
[CAS# 140-59-0]

Identification

• Classification: Chemical reagent >> Organic reagent >> Imine, amidine
• Name: Stilbamidine Isetionate
• Synonyms: 4-[(E)-2-(4-Carbamimidoylphenyl)Vinyl]Benzamidine; 2-Hydroxyethanesulfonic Acid; 4-[(E)-2-(4-Amidinophenyl)Vinyl]Benzamidine; 2-Hydroxyethanesulfonic Acid; Stilbamidine Isetionate
• Molecular Formula: C₂₀H₂₈N₄O₈S₂
• Molecular Weight: 516.58
• CAS Registry Number: 140-59-0
• EINECS: 205-421-5
• SMILES: C1=CC(=CC=C1\C=C\C2=CC=C(C(N)=N)C=C2)C(N)=N.C([S](O)(=O)=O)CO.C([S](O)(=O)=O)CO
• InChI: 1S/C16H16N4.2C2H6O4S/c17-15(18)13-7-3-11(4-8-13)1-2-12-5-9-14(10-6-12)16(19)20;2*3-1-2-7(4,5)6/h1-10H,(H3,17,18)(H3,19,20);2*3H,1-2H2,(H,4,5,6)/b2-1+
• InChIKey: DXBSRDIXJYTKNV-SEPHDYHBSA-N

Properties

• Boiling point: 456.4°C at 760 mmHg (Cal.)
• Flash point: 229.8°C (Cal.)